1,4-Dideoxy-1,4-Imino-D-Xylitol
TL;DR: 1,4-Dideoxy-1,4-Imino-D-Xylitol (CAS 97058-12-3) is a chemical compound with molecular formula C5H11NO3 and molecular weight 133.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4S)-2-(hydroxymethyl)pyrrolidine-3,4-diol
Also Known As: 1,4-dideoxy-1,4-imino-D-xylitol, (2r,3s,4s)-2-(hydroxymethyl)pyrrolidine-3,4-diol, (2R,3S,4S)-3,4-dihydroxyprolinol, (3s,4s,5r)-5-(hydroxymethyl)pyrrolidine-3,4-diol, (2R)-2alpha-(Hydroxymethyl)pyrrolidine-3alpha,4beta-diol
| Molecular Formula | C5H11NO3 |
|---|---|
| Molecular Weight | 133.07 g/mol |
| LogP | -2.3277 |
| Topological Polar Surface Area | 72.72 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.0739 |
| Heavy Atoms | 9 |
| Complexity | 98.203896 |
Chemical Identifiers
| CAS Number | 97058-12-3 |
|---|---|
| SMILES | C1[C@@H]([C@H]([C@H](N1)CO)O)O |
Product Overview
1,4-Dideoxy-1,4-Imino-D-Xylitol (CAS 97058-12-3), with molecular formula C5H11NO3 and molecular weight 133.07 g/mol. IUPAC: (2R,3S,4S)-2-(hydroxymethyl)pyrrolidine-3,4-diol.
Chemical Property Profile of 1,4-Dideoxy-1,4-Imino-D-Xylitol
Property Insights of 1,4-Dideoxy-1,4-Imino-D-Xylitol
The XLogP value of -2.3277 indicates that 1,4-Dideoxy-1,4-Imino-D-Xylitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dideoxy-1,4-Imino-D-Xylitol. Following Lipinski's Rule of Five, 1,4-Dideoxy-1,4-Imino-D-Xylitol has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Dideoxy-1,4-Imino-D-Xylitol?
The CAS number of 1,4-Dideoxy-1,4-Imino-D-Xylitol is 97058-12-3.
What is the molecular formula of 1,4-Dideoxy-1,4-Imino-D-Xylitol?
The molecular formula of 1,4-Dideoxy-1,4-Imino-D-Xylitol is C5H11NO3.
What is the molecular weight of 1,4-Dideoxy-1,4-Imino-D-Xylitol?
The molecular weight of 1,4-Dideoxy-1,4-Imino-D-Xylitol is 133.07 g/mol.
Where can I buy 1,4-Dideoxy-1,4-Imino-D-Xylitol?
You can request a quote for 1,4-Dideoxy-1,4-Imino-D-Xylitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dideoxy-1,4-Imino-D-Xylitol?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dideoxy-1,4-Imino-D-Xylitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.